N-cyclopentyl-1-({(2S)-1-[(3-methoxyphenyl)carbamoyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-cyclopentyl-1-({(2S)-1-[(3-methoxyphenyl)carbamoyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
N-cyclopentyl-1-({(2S)-1-[(3-methoxyphenyl)carbamoyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB20-1501 |
| Compound Name: | N-cyclopentyl-1-({(2S)-1-[(3-methoxyphenyl)carbamoyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 412.49 |
| Molecular Formula: | C21 H28 N6 O3 |
| Smiles: | COc1cccc(c1)NC(N1CCC[C@H]1Cn1cc(C(NC2CCCC2)=O)nn1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.37 |
| logD: | 2.37 |
| logSw: | -2.8646 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.281 |
| InChI Key: | PPZIBIZDPOAGPF-KRWDZBQOSA-N |